Bionet1_001863
TL;DR: Bionet1_001863 (CAS 303148-37-0) is a chemical compound with molecular formula C16H14ClF3N6O and molecular weight 398.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-6-[2-(dimethylamino)ethenyl]-4-oxopyrimidine-5-carbonitrile
Also Known As: Bionet1_001863, 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl](methyl)amino]-6-[2-(dimethylamino)vinyl]-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile, 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-methylamino]-6-[2-(dimethylamino)ethenyl]-4-oxopyrimidine-5-carbonitrile
| Molecular Formula | C16H14ClF3N6O |
|---|---|
| Molecular Weight | 398.09 g/mol |
| LogP | 2.61398 |
| Topological Polar Surface Area | 78.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.08698 |
| Heavy Atoms | 27 |
| Complexity | 977.58673 |
Chemical Identifiers
| CAS Number | 303148-37-0 |
|---|---|
| SMILES | CN(C)C=CC1=C(C(=O)N=CN1N(C)C2=C(C=C(C=N2)C(F)(F)F)Cl)C#N |
Product Overview
Bionet1_001863 (CAS 303148-37-0), with molecular formula C16H14ClF3N6O and molecular weight 398.09 g/mol. IUPAC: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-methylamino]-6-[2-(dimethylamino)ethenyl]-4-oxopyrimidine-5-carbonitrile.
Chemical Property Profile of Bionet1_001863
Property Insights of Bionet1_001863
The XLogP value of 2.61398 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_001863. The TPSA of 78.05 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_001863. Following Lipinski's Rule of Five, Bionet1_001863 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bionet1_001863?
The CAS number of Bionet1_001863 is 303148-37-0.
What is the molecular formula of Bionet1_001863?
The molecular formula of Bionet1_001863 is C16H14ClF3N6O.
What is the molecular weight of Bionet1_001863?
The molecular weight of Bionet1_001863 is 398.09 g/mol.
Where can I buy Bionet1_001863?
You can request a quote for Bionet1_001863 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_001863?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_001863 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.